3-amino-3-[[[methyl(propyl)sulfamoyl]amino]methyl]pentane;hydrochloride

C10H26ClN3O2S — CID 119989719

IUPAC3-amino-3-[[[methyl(propyl)sulfamoyl]amino]methyl]pentane;hydrochloride
SMILESCCCN(C)S(=O)(=O)NCC(N)(CC)CC.Cl
InChIInChI=1S/C10H25N3O2S.ClH/c1-5-8-13(4)16(14,15)12-9-10(11,6-2)7-3;/h12H,5-9,11H2,1-4H3;1H
InChIKeyCZEIBSDXMKRRKC-UHFFFAOYSA-N
MW287.86 g/mol
LogP1.10
Rot. Bonds8

About 3-amino-3-[[[methyl(propyl)sulfamoyl]amino]methyl]pentane;hydrochloride

3-amino-3-[[[methyl(propyl)sulfamoyl]amino]methyl]pentane;hydrochloride (PubChem CID 119989719) has the molecular formula C10H26ClN3O2S and a molecular weight of 287.86 g/mol. Its IUPAC name is 3-amino-3-[[[methyl(propyl)sulfamoyl]amino]methyl]pentane;hydrochloride.

Molecular Properties

Compound Name3-amino-3-[[[methyl(propyl)sulfamoyl]amino]methyl]pentane;hydrochloride
PubChem CID119989719
Molecular FormulaC10H26ClN3O2S
Molecular Weight287.86 g/mol
Exact Mass287.14
IUPAC Name3-amino-3-[[[methyl(propyl)sulfamoyl]amino]methyl]pentane;hydrochloride
SMILESCCCN(C)S(=O)(=O)NCC(N)(CC)CC.Cl
InChIInChI=1S/C10H25N3O2S.ClH/c1-5-8-13(4)16(14,15)12-9-10(11,6-2)7-3;/h12H,5-9,11H2,1-4H3;1H
InChIKeyCZEIBSDXMKRRKC-UHFFFAOYSA-N
XLogP1.10
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.86
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-3-[[[methyl(propyl)sulfamoyl]amino]methyl]pentane;hydrochloride?
The IUPAC name of 3-amino-3-[[[methyl(propyl)sulfamoyl]amino]methyl]pentane;hydrochloride (CID 119989719) is 3-amino-3-[[[methyl(propyl)sulfamoyl]amino]methyl]pentane;hydrochloride.
What is the SMILES notation for 3-amino-3-[[[methyl(propyl)sulfamoyl]amino]methyl]pentane;hydrochloride?
The canonical SMILES for 3-amino-3-[[[methyl(propyl)sulfamoyl]amino]methyl]pentane;hydrochloride is CCCN(C)S(=O)(=O)NCC(N)(CC)CC.Cl.
What is the InChIKey of 3-amino-3-[[[methyl(propyl)sulfamoyl]amino]methyl]pentane;hydrochloride?
The InChIKey is CZEIBSDXMKRRKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25N3O2S.ClH/c1-5-8-13(4)16(14,15)12-9-10(11,6-2)7-3;/h12H,5-9,11H2,1-4H3;1H.
What are the key properties of 3-amino-3-[[[methyl(propyl)sulfamoyl]amino]methyl]pentane;hydrochloride?
3-amino-3-[[[methyl(propyl)sulfamoyl]amino]methyl]pentane;hydrochloride has a molecular weight of 287.86 g/mol, XLogP of 1.10, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3-[[[methyl(propyl)sulfamoyl]amino]methyl]pentane;hydrochloride is sourced from PubChem (CID 119989719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).